Home Sulfos Cyanomethyl p-toluenesulfonate

Cyanomethyl p-toluenesulfonate

CAS No.:
14562-04-0
Catalog Number:
AG001D8J
Molecular Formula:
C9H9NO3S
Molecular Weight:
211.2377
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
In Stock USA
United States
$150
- +
1g
97%
In Stock USA
United States
$313
- +
5g
95%
In Stock USA
United States
$895
- +
Product Description
Catalog Number:
AG001D8J
Chemical Name:
Cyanomethyl p-toluenesulfonate
CAS Number:
14562-04-0
Molecular Formula:
C9H9NO3S
Molecular Weight:
211.2377
MDL Number:
MFCD00019827
IUPAC Name:
cyanomethyl 4-methylbenzenesulfonate
InChI:
InChI=1S/C9H9NO3S/c1-8-2-4-9(5-3-8)14(11,12)13-7-6-10/h2-5H,7H2,1H3
InChI Key:
PFXOLUYGXYEFOR-UHFFFAOYSA-N
SMILES:
N#CCOS(=O)(=O)c1ccc(cc1)C
EC Number:
238-604-3
Properties
Complexity:
314  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.03g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
211.235g/mol
Monoisotopic Mass:
211.03g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
75.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties